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Compound Detail

CHEMBL3233512

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O=C(O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3233512
Phase Preclinical
Structure Type MOL
InChI Key LDPLFHGGZNSKDS-FTBFGRRBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

344.3
MW (Da)
-1.34
ALogP
9
HBA
7
HBD
185.0
PSA (Ų)
0.26
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C14H16O10
MW 344.27
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness 2.12

Literature References

PubMed DOI Target Context # Activities
24613627 10.1016/j.bmc.2014.02.014 Neuraminidase 2
24613627 10.1016/j.bmc.2014.02.014 Genome polyprotein 2

Data from ChEMBL 36 via Core Engine